SCHEMBL14701153

SCHEMBL14701153

COc1ccc(C2(c3ccc(OC)cc3)CCc3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.50
AKR1B1 P15121 2/20 0.47
OPRM1 P35372 1/20 0.46
OPRL1 P41146 1/20 0.46
KIF11 P52732 1/20 0.44
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.42
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
SLC6A3 Q01959 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40
MAPT P10636 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7453510 0.82 ATM (0.51) SIGMAR1AKR1B1OPRM1OPRL1KIF11
SCHEMBL6337745 0.80 HDAC9 (0.49) SIGMAR1AKR1B1DRD2
SCHEMBL13096616 0.78 KIF11 (0.48) SIGMAR1AKR1B1OPRM1OPRL1KIF11
SCHEMBL6552454 0.77 KDM1A (0.44) POLBMAPT
SCHEMBL2777451 0.77 KDM1A (0.41) MAPT
SCHEMBL2946113 0.77 ALDH1A1 (0.46) SIGMAR1
SCHEMBL7321561 0.76 SIGMAR1 (0.51) SIGMAR1AKR1B1OPRM1OPRL1KIF11
SCHEMBL28633914 0.76 PDK2 (0.40) OPRM1
SCHEMBL21829167 0.76 HDAC9 (0.36) AKR1B1KIF11POLBMAPT
SCHEMBL21829153 0.75 THRB (0.38) SIGMAR1KIF11POLBMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230235115-A1 ESTER COMPOUND AND RESIN COMPOSITION AJINOMOTO CO., INC. (JP) 2023-07-27 US disclosed
US-20230235115-A1 ESTER COMPOUND AND RESIN COMPOSITION AJINOMOTO CO., INC. (JP) 2023-07-27 US disclosed
US-8664289-B2 Dye and coloring photosensitive composition ADEKA CORPORATION (JP) 2014-03-04 US disclosed
US-8664289-B2 Dye and coloring photosensitive composition ADEKA CORPORATION (JP) 2014-03-04 US disclosed
US-20130041062-A1 DYE AND COLORING PHOTOSENSITIVE COMPOSITION ADEKA CORPORATION (JP) 2013-02-14 US disclosed
US-20130041062-A1 DYE AND COLORING PHOTOSENSITIVE COMPOSITION ADEKA CORPORATION (JP) 2013-02-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130041062-A1 DYE AND COLORING PHOTOSENSITIVE COMPOSITION IK, CRY1, ABCG2 SIGMAR1 2636/4885AKR1B1 682/4885OPRM1 4790/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.